3-bromo-4-(piperidin-4-ylmethoxy)pyridine

C11H15BrN2O — CID 104779217

IUPAC3-bromo-4-(piperidin-4-ylmethoxy)pyridine
SMILESBrc1cnccc1OCC1CCNCC1
InChIInChI=1S/C11H15BrN2O/c12-10-7-14-6-3-11(10)15-8-9-1-4-13-5-2-9/h3,6-7,9,13H,1-2,4-5,8H2
InChIKeyXOGIHBWSOUSOOD-UHFFFAOYSA-N
MW271.16 g/mol
LogP2.22
Rot. Bonds3

About 3-bromo-4-(piperidin-4-ylmethoxy)pyridine

3-bromo-4-(piperidin-4-ylmethoxy)pyridine (PubChem CID 104779217) has the molecular formula C11H15BrN2O and a molecular weight of 271.16 g/mol. Its IUPAC name is 3-bromo-4-(piperidin-4-ylmethoxy)pyridine.

Molecular Properties

Compound Name3-bromo-4-(piperidin-4-ylmethoxy)pyridine
PubChem CID104779217
Molecular FormulaC11H15BrN2O
Molecular Weight271.16 g/mol
Exact Mass270.04
IUPAC Name3-bromo-4-(piperidin-4-ylmethoxy)pyridine
SMILESBrc1cnccc1OCC1CCNCC1
InChIInChI=1S/C11H15BrN2O/c12-10-7-14-6-3-11(10)15-8-9-1-4-13-5-2-9/h3,6-7,9,13H,1-2,4-5,8H2
InChIKeyXOGIHBWSOUSOOD-UHFFFAOYSA-N
XLogP2.22
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.16
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-methyl-4-(piperidin-4-ylmethoxy)pyridine;dihydrochloride
CID 154582386
4-(piperidin-4-ylmethoxy)-3-(trifluoromethyl)pyridine
CID 166105232
4-bromo-3-(cyclopropylmethoxy)pyridine
CID 90156558
4-fluoro-3-(piperidin-4-ylmethoxy)pyridine
CID 142361424
tert-butyl formate;3-nitro-4-(piperidin-4-ylmethoxy)pyridine
CID 175294004
2-(piperidin-4-ylmethoxy)pyrazine;hydrochloride
CID 71636924
3-(cyclopropylmethoxy)-4-methoxypyridine
CID 150318193
2-bromo-5-(piperidin-4-ylmethoxy)pyridine;hydrochloride
CID 118109642
6-(cyclopropylmethoxy)isoquinolin-5-amine
CID 106948623
5-bromo-4-(cyclopropylmethoxy)-2-methylpyridine
CID 144638458
5-bromo-4-(cyclopropylmethoxy)pyrimidine
CID 66320949
7-chloro-4-(piperidin-4-ylmethoxy)quinoline
CID 62348670

Frequently Asked Questions

What is the IUPAC name of 3-bromo-4-(piperidin-4-ylmethoxy)pyridine?
The IUPAC name of 3-bromo-4-(piperidin-4-ylmethoxy)pyridine (CID 104779217) is 3-bromo-4-(piperidin-4-ylmethoxy)pyridine.
What is the SMILES notation for 3-bromo-4-(piperidin-4-ylmethoxy)pyridine?
The canonical SMILES for 3-bromo-4-(piperidin-4-ylmethoxy)pyridine is Brc1cnccc1OCC1CCNCC1.
What is the InChIKey of 3-bromo-4-(piperidin-4-ylmethoxy)pyridine?
The InChIKey is XOGIHBWSOUSOOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15BrN2O/c12-10-7-14-6-3-11(10)15-8-9-1-4-13-5-2-9/h3,6-7,9,13H,1-2,4-5,8H2.
What are the key properties of 3-bromo-4-(piperidin-4-ylmethoxy)pyridine?
3-bromo-4-(piperidin-4-ylmethoxy)pyridine has a molecular weight of 271.16 g/mol, XLogP of 2.22, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-4-(piperidin-4-ylmethoxy)pyridine is sourced from PubChem (CID 104779217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).